5-(3-chloro-5-fluorophenyl)-2-methoxyphenol

C13H10ClFO2 — CID 53220924

IUPAC5-(3-chloro-5-fluorophenyl)-2-methoxyphenol
SMILESCOc1ccc(-c2cc(F)cc(Cl)c2)cc1O
InChIInChI=1S/C13H10ClFO2/c1-17-13-3-2-8(6-12(13)16)9-4-10(14)7-11(15)5-9/h2-7,16H,1H3
InChIKeyPGNQRLGHMCTIPC-UHFFFAOYSA-N
MW252.67 g/mol
LogP3.86
Rot. Bonds2

About 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol

5-(3-chloro-5-fluorophenyl)-2-methoxyphenol (PubChem CID 53220924) has the molecular formula C13H10ClFO2 and a molecular weight of 252.67 g/mol. Its IUPAC name is 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol.

Molecular Properties

Compound Name5-(3-chloro-5-fluorophenyl)-2-methoxyphenol
PubChem CID53220924
Molecular FormulaC13H10ClFO2
Molecular Weight252.67 g/mol
Exact Mass252.04
IUPAC Name5-(3-chloro-5-fluorophenyl)-2-methoxyphenol
SMILESCOc1ccc(-c2cc(F)cc(Cl)c2)cc1O
InChIInChI=1S/C13H10ClFO2/c1-17-13-3-2-8(6-12(13)16)9-4-10(14)7-11(15)5-9/h2-7,16H,1H3
InChIKeyPGNQRLGHMCTIPC-UHFFFAOYSA-N
XLogP3.86
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.67
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dichloro-5-(4-fluoro-3-methoxyphenyl)benzene
CID 134623746
5-(2-fluoro-5-methylphenyl)-2-methoxyphenol
CID 53220775
1,3-dichloro-5-(4-chloro-3-methoxyphenyl)benzene
CID 118811160
3-chloro-5-(3-chloro-5-fluorophenyl)phenol
CID 53221372
2-methoxy-5-naphthalen-2-ylphenol
CID 53220915
5-(2-chloropyrimidin-4-yl)-2-methoxyphenol
CID 91620392
4-(3-chloro-5-fluorophenyl)-2-methylaniline
CID 115504609
5-(2-fluoro-4-methoxyphenyl)-2-methoxyphenol
CID 53220882
4-fluoro-3-(3-hydroxy-4-methoxyphenyl)benzoic acid
CID 53220977
2-chloro-4-(3-chloro-5-fluorophenyl)aniline
CID 107607732
2-methoxy-5-[3-(trifluoromethoxy)phenyl]phenol
CID 53221067
4-(3,5-difluorophenyl)-2-methoxybenzoic acid
CID 53225906

Frequently Asked Questions

What is the IUPAC name of 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol?
The IUPAC name of 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol (CID 53220924) is 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol.
What is the SMILES notation for 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol?
The canonical SMILES for 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol is COc1ccc(-c2cc(F)cc(Cl)c2)cc1O.
What is the InChIKey of 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol?
The InChIKey is PGNQRLGHMCTIPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFO2/c1-17-13-3-2-8(6-12(13)16)9-4-10(14)7-11(15)5-9/h2-7,16H,1H3.
What are the key properties of 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol?
5-(3-chloro-5-fluorophenyl)-2-methoxyphenol has a molecular weight of 252.67 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chloro-5-fluorophenyl)-2-methoxyphenol is sourced from PubChem (CID 53220924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).